4-tert-butyl-N-[4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[(4-ethoxybenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[[[[(4-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[(4-ethoxybenzoyl)carbamothioylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[(4-ethoxybenzoyl)thiocarbamoylamino]phenyl]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H29N3O3S/c1-5-33-23-16-8-19(9-17-23)25(32)30-26(34)29-22-14-12-21(13-15-22)28-24(31)18-6-10-20(11-7-18)27(2,3)4/h6-17H,5H2,1-4H3,(H,28,31)(H2,29,30,32,34)